4-[1-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-2H-phthalazin-1-one

Systemtic Name: 4-[1-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-1-oxidanylidene-propan-2-yl]-2H-phthalazin-1-one Openeye Name: 4-[1-methyl-2-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]-1-piperidyl]-2-oxo-ethyl]-2H-phthalazin-1-one CAS Name: 4-[1-[4-[2-methyl-5-(trifluoromethyl)-1-benzimidazolyl]-1-piperidinyl]-1-oxopropan-2-yl]-2H-phthalazin-1-one IUPAC Name: 4-[1-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidin-1-yl]-1-oxopropan-2-yl]-2H-phthalazin-1-one Traditional Name: 4-[2-keto-1-methyl-2-[4-[2-methyl-5-(trifluoromethyl)benzimidazol-1-yl]piperidino]ethyl]-2H-phthalazin-1-one Formula: C25H24F3N5O2 MolecularWeight: 483.48557

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1C3CCN(CC3)C(=O)C(C)C4=NNC(=O)C5=CC=CC=C54)C=CC(=C2)C(F)(F)F

Isomeric SMILES

CC1=NC2=C(N1C3CCN(CC3)C(=O)C(C)C4=NNC(=O)C5=CC=CC=C54)C=CC(=C2)C(F)(F)F

InChI

InChI=1S/C25H24F3N5O2/c1-14(22-18-5-3-4-6-19(18)23(34)31-30-22)24(35)32-11-9-17(10-12-32)33-15(2)29-20-13-16(25(26,27)28)7-8-21(20)33/h3-8,13-14,17H,9-12H2,1-2H3,(H,31,34)